2-[[(E)-3-(3-fluorophenyl)prop-2-enoyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[(E)-3-(3-fluorophenyl)prop-2-enoyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[(E)-3-(3-fluorophenyl)prop-2-enoyl]-methyl-amino]acetic acid CAS Name: 2-[[(E)-3-(3-fluorophenyl)-1-oxoprop-2-enyl]-methylamino]acetic acid IUPAC Name: 2-[[(E)-3-(3-fluorophenyl)prop-2-enoyl]-methylamino]acetic acid Traditional Name: 2-[[(E)-3-(3-fluorophenyl)acryloyl]-methyl-amino]acetic acid Formula: C12H12FNO3 MolecularWeight: 237.226983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C=CC1=CC(=CC=C1)F

Isomeric SMILES

CN(CC(=O)O)C(=O)/C=C/C1=CC(=CC=C1)F

InChI

InChI=1S/C12H12FNO3/c1-14(8-12(16)17)11(15)6-5-9-3-2-4-10(13)7-9/h2-7H,8H2,1H3,(H,16,17)/b6-5+